Information card for entry 4346543

Structure parameters

• Formula: C40 H37 F6 N4 O0.5 P2 Pt
• Calculated formula: C40 H37 F6 N4 O0.5 P2 Pt
• Title of publication: Exploring the Transphobia Effect on Heteroleptic NHC Cycloplatinated Complexes.
• Authors of publication: Fuertes, Sara; Chueca, Andrés J; Sicilia, Violeta
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 20
• Pages of publication: 9885 - 9895
• a: 14.8874 ± 0.0001 Å
• b: 14.5664 ± 0.0001 Å
• c: 18.5904 ± 0.0002 Å
• α: 90°
• β: 91.617 ± 0.001°
• γ: 90°
• Cell volume: 4029.83 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0443
• Residual factor for significantly intense reflections: 0.0371
• Weighted residual factors for significantly intense reflections: 0.0979
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No